N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide

C15H28N2O3 — CID 106361521

IUPACN-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCCCC2CO)CCNCC1
InChIInChI=1S/C15H28N2O3/c1-20-11-15(6-8-16-9-7-15)14(19)17-13-5-3-2-4-12(13)10-18/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeyBYPCGGZUVUQKCX-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.67
Rot. Bonds5

About N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide

N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 106361521) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID106361521
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC NameN-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCCCC2CO)CCNCC1
InChIInChI=1S/C15H28N2O3/c1-20-11-15(6-8-16-9-7-15)14(19)17-13-5-3-2-4-12(13)10-18/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeyBYPCGGZUVUQKCX-UHFFFAOYSA-N
XLogP0.67
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(hydroxymethyl)cyclohexyl]-3-propylpyrrolidine-3-carboxamide
CID 106361369
N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120636117
4-ethyl-N-(2-ethylcyclohexyl)piperidine-4-carboxamide
CID 63128033
N-[2-(hydroxymethyl)cyclopentyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 114178691
N-cyclohex-3-en-1-yl-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042043
N-[4-(cyclohexylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120625325
1-(aminomethyl)-N-[2-(hydroxymethyl)cyclopentyl]cyclopentane-1-carboxamide
CID 103811415
N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
N-(1,3-dihydroxy-2-methylpropan-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042054
[(1R,2R)-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 141194189
N-(3-amino-2-hydroxy-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114154115
methyl N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]carbamate
CID 130640113

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide (CID 106361521) is N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)NC2CCCCC2CO)CCNCC1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is BYPCGGZUVUQKCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-20-11-15(6-8-16-9-7-15)14(19)17-13-5-3-2-4-12(13)10-18/h12-13,16,18H,2-11H2,1H3,(H,17,19).
What are the key properties of N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide?
N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 0.67, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclohexyl]-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 106361521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).